4,6-dimethyl-2-methylsulfanyl-5-phenacyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-methylsulfanyl-5-phenacyl-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-methylsulfanyl-5-phenacyl-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-(methylthio)-5-phenacyl-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-methylsulfanyl-5-phenacylpyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-2-(methylthio)-5-phenacyl-nicotinonitrile Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1CC(=O)C2=CC=CC=C2)C)SC)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1CC(=O)C2=CC=CC=C2)C)SC)C#N

InChI

InChI=1S/C17H16N2OS/c1-11-14(9-16(20)13-7-5-4-6-8-13)12(2)19-17(21-3)15(11)10-18/h4-8H,9H2,1-3H3